[1-[(3-chlorophenyl)amino]-1-oxidanylidene-butan-2-yl] 8-(1,3-benzoxazol-2-yl)naphthalene-1-carboxylate

Systemtic Name: [1-[(3-chlorophenyl)amino]-1-oxidanylidene-butan-2-yl] 8-(1,3-benzoxazol-2-yl)naphthalene-1-carboxylate Openeye Name: 1-[(3-chlorophenyl)carbamoyl]propyl 8-(1,3-benzoxazol-2-yl)naphthalene-1-carboxylate CAS Name: 8-(1,3-benzoxazol-2-yl)-1-naphthalenecarboxylic acid [1-(3-chloroanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(3-chloroanilino)-1-oxobutan-2-yl] 8-(1,3-benzoxazol-2-yl)naphthalene-1-carboxylate Traditional Name: 8-(1,3-benzoxazol-2-yl)naphthalene-1-carboxylic acid 1-[(3-chlorophenyl)carbamoyl]propyl ester Formula: C28H21ClN2O4 MolecularWeight: 484.93034

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=CC=C1)Cl)OC(=O)C2=CC=CC3=C2C(=CC=C3)C4=NC5=CC=CC=C5O4

Isomeric SMILES

CCC(C(=O)NC1=CC(=CC=C1)Cl)OC(=O)C2=CC=CC3=C2C(=CC=C3)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C28H21ClN2O4/c1-2-23(26(32)30-19-11-7-10-18(29)16-19)35-28(33)21-13-6-9-17-8-5-12-20(25(17)21)27-31-22-14-3-4-15-24(22)34-27/h3-16,23H,2H2,1H3,(H,30,32)